Chemical ID: 3990521

CC1CC(CN(C1)S(=O)(=O)c2ccc(cc2)C(=O)O)C
Chemical ID:
3990521
Name [?]:
4-[(3,5-dimethyl-1-piperidyl)sulfonyl]benzoic acid
SMILES [?]:
CC1CC(CN(C1)S(=O)(=O)c2ccc(cc2)C(=O)O)C
InChi [?]:
None
InChi Info:
None

Chemical Details

Atom Count
Formula:C14H19NO4S
All Atoms:20
Heavy Atoms:20
Chiral Atoms:2
ZAP Information [?]
Total:9.36354
Area:479.363
Solvation:-2.62052
Coulombic:-35.8864
Bond Count [?]
All:21
Single:15
Double:6
Rotors:3
Chiral:0
Rigid Segments:4
Chemical Properties
Molecular Weight:297.371
H-Bond Donors:1
H-Bond Acceptors:5
XLogP:2.18
LogP (Chemaxon):2.22

Name Annotations

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Experimental Annotations

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Descriptor Annotations

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